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2-(2,4-Dichlorophenoxy)-N-(2-hydroxy-1,1-dimethylethyl)acetamide, trifluoroacetate
SpectraBase Compound ID 5M9IxySEgcu
InChI InChI=1S/C14H14Cl2F3NO4/c1-13(2,7-24-12(22)14(17,18)19)20-11(21)6-23-10-4-3-8(15)5-9(10)16/h3-5H,6-7H2,1-2H3,(H,20,21)
InChIKey OWDFTYJXRONKCZ-UHFFFAOYSA-N
Mol Weight 388.17 g/mol
Molecular Formula C14H14Cl2F3NO4
Exact Mass 387.025198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2IIzfgDPE0i
Name 2-(2,4-Dichlorophenoxy)-N-(2-hydroxy-1,1-dimethylethyl)acetamide, trifluoroacetate
Comments Computed using HOSE algorithm
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Exact Mass 387.025197820 u
Formula C14H14Cl2F3NO4
InChI InChI=1S/C14H14Cl2F3NO4/c1-13(2,7-24-12(22)14(17,18)19)20-11(21)6-23-10-4-3-8(15)5-9(10)16/h3-5H,6-7H2,1-2H3,(H,20,21)
InChIKey OWDFTYJXRONKCZ-UHFFFAOYSA-N
Molecular Weight 388.170 g/mol
SMILES C1(Cl)=C(C=CC(=C1)Cl)OCC(=O)NC(COC(C(F)(F)F)=O)(C)C